| SpectraBase Spectrum ID |
4bZFSudVC8c |
| Name |
ADB-CHMICA artifact (deamino-) MS2 |
| Comments |
F: ITMS + c ESI d w Full ms2 353.30 |
| Copyright |
Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C22H29N2O2 |
| InChI |
InChI=1S/C22H28N2O2/c1-22(2,3)20(15-25)23-21(26)18-14-24(13-16-9-5-4-6-10-16)19-12-8-7-11-17(18)19/h7-8,11-12,14,16,20H,4-6,9-10,13H2,1-3H3/p+1 |
| InChIKey |
KZMCOOQDUIJECJ-UHFFFAOYSA-O |
| Ion Polarity |
P |
| Ionization Type |
ESI |
| SMILES |
N(C(C=1C2=C(C=CC=C2)N(C1)CC1CCCCC1)=O)C([C+]=O)C(C)(C)C |
| Sample Comments |
The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database. |
| Sample Description |
Analyte Type: Parent |
| Source of Spectrum |
Maurer/Wissenbach/Weber, Saarland University |
| Spectrum Type |
ms2 |
| Technique |
ITMS |
